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4-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]-2-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-1(2H)-phthalazinone
SpectraBase Compound ID DBugSxvaan5
InChI InChI=1S/C31H33N5O5S/c1-23-11-12-24(21-28(23)42(39,40)35-17-19-41-20-18-35)30-26-9-5-6-10-27(26)31(38)36(32-30)22-29(37)34-15-13-33(14-16-34)25-7-3-2-4-8-25/h2-12,21H,13-20,22H2,1H3
InChIKey XZFACFWTYVBQKW-UHFFFAOYSA-N
Mol Weight 587.7 g/mol
Molecular Formula C31H33N5O5S
Exact Mass 587.22024 g/mol

1H Nuclear Magnetic Resonance (NMR) Spectrum

1H Nuclear Magnetic Resonance (NMR) Spectrum

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SpectraBase Spectrum ID HAziF0K8VAg
Name 4-[4-methyl-3-(4-morpholinylsulfonyl)phenyl]-2-[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]-1(2H)-phthalazinone
Copyright Copyright © 2022-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2022-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 587.220240352 u
Formula C31H33N5O5S
InChI InChI=1S/C31H33N5O5S/c1-23-11-12-24(21-28(23)42(39,40)35-17-19-41-20-18-35)30-26-9-5-6-10-27(26)31(38)36(32-30)22-29(37)34-15-13-33(14-16-34)25-7-3-2-4-8-25/h2-12,21H,13-20,22H2,1H3
InChIKey XZFACFWTYVBQKW-UHFFFAOYSA-N
Molecular Weight 587.695 g/mol
NMR Offset 18.0068
NMR Spectrometer Frequency 500.134
Observed nucleus 1H
Sample State Soluted
Sample_ID 1H_CB_2020_2233
Solvent DMSO-d6
Source Vendor ID: NMR/12279140